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Assay Detail

CHEMBL4145115

Review assay metadata, readout intent, target linkage, and publication context from the same page.

Binding
Displacement of [3H]-CGP12177 from human beta2 ADR expressed in HEK293T cell membrane after 90 mins by scintillation counting
21
Total Activities
21
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Organism Homo sapiens
Confidence 9 — Direct single protein target
Curated By Autocuration

Target

Beta-2 adrenergic receptor (CHEMBL210)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Discovery of β-Adrenergic Receptors Blocker-Carbonic Anhydrase Inhibitor Hybrids for Multitargeted Antiglaucoma Therapy.
Nocentini A, Ceruso M, Bua S, Lomelino CL, Andring JT, McKenna R, Lanzi C, Sgambellone S, Pecori R, Matucci R, Filippi L, Gratteri P, Carta F, Masini E, Selleri S, Supuran CT.
J Med Chem (2018) 61 : 5380 -5394
PubMed 29851481 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
Ki 21 5.84 9.68

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL499 TIMOLOL 4.0 1 9.68
CHEMBL27 PROPRANOLOL 4.0 1 8.76
CHEMBL4161638 1 5.30
CHEMBL24 ATENOLOL 4.0 1 5.02
CHEMBL4170519 1 4.55
CHEMBL4163665 1 4.52
CHEMBL4174345 1 4.50
CHEMBL4162590 1 4.40
CHEMBL4167473 1 -
CHEMBL4159562 1 -
CHEMBL4170860 1 -
CHEMBL4162920 1 -
CHEMBL4174295 1 -
CHEMBL4166379 1 -
CHEMBL4167532 1 -
CHEMBL4175397 1 -
CHEMBL4170908 1 -
CHEMBL4174691 1 -
CHEMBL4170536 1 -
CHEMBL4173735 1 -
CHEMBL4160295 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL499 TIMOLOL Ki = 0.2089 nM 9.68
CHEMBL27 PROPRANOLOL Ki = 1.738 nM 8.76
CHEMBL4161638 Ki = 5011.87 nM 5.30
CHEMBL24 ATENOLOL Ki = 9549.93 nM 5.02
CHEMBL4170519 Ki = 28183.83 nM 4.55
CHEMBL4163665 Ki = 30199.52 nM 4.52
CHEMBL4174345 Ki = 31622.78 nM 4.50
CHEMBL4162590 Ki = 39810.72 nM 4.40
CHEMBL4167473 Ki > 100000.0 nM -
CHEMBL4159562 Ki > 100000.0 nM -
CHEMBL4170860 Ki > 100000.0 nM -
CHEMBL4162920 Ki > 100000.0 nM -
CHEMBL4174295 Ki > 100000.0 nM -
CHEMBL4166379 Ki > 100000.0 nM -
CHEMBL4167532 Ki > 100000.0 nM -
CHEMBL4175397 Ki > 100000.0 nM -
CHEMBL4170908 Ki > 100000.0 nM -
CHEMBL4174691 Ki > 100000.0 nM -
CHEMBL4170536 Ki > 100000.0 nM -
CHEMBL4173735 Ki > 100000.0 nM -
CHEMBL4160295 Ki > 100000.0 nM -